Zhang Lab

National University of Singapore

Home Research COVID-19 Services Publications People Teaching Job Opening News Forum Lab Only

Online Services

●I-TASSER ●I-TASSER-MTD ●C-I-TASSER ●CR-I-TASSER ●QUARK ●C-QUARK ●LOMETS ●MUSTER ●CEthreader ●SEGMER ●DeepFold ●DeepFoldRNA ●FoldDesign ●COFACTOR ●COACH ●MetaGO ●TripletGO ●IonCom ●FG-MD ●ModRefiner ●REMO ●DEMO ●DEMO-EM ●SPRING ●COTH ●Threpp ●PEPPI ●BSpred ●ANGLOR ●EDock ●BSP-SLIM ●SAXSTER ●FUpred ●ThreaDom ●ThreaDomEx ●EvoDesign ●BindProf ●BindProfX ●SSIPe ●GPCR-I-TASSER ●MAGELLAN ●ResQ ●STRUM ●DAMpred

●TM-score ●TM-align ●US-align ●MM-align ●RNA-align ●NW-align ●LS-align ●EDTSurf ●MVP ●MVP-Fit ●SPICKER ●HAAD ●PSSpred ●3DRobot ●MR-REX ●I-TASSER-MR ●SVMSEQ ●NeBcon ●ResPRE ●TripletRes ●DeepPotential ●WDL-RF ●ATPbind ●DockRMSD ●DeepMSA ●FASPR ●EM-Refiner ●GPU-I-TASSER

●BioLiP ●E. coli ●GLASS ●GPCR-HGmod ●GPCR-RD ●GPCR-EXP ●Tara-3D ●TM-fold ●DECOYS ●POTENTIAL ●RW/RWplus ●EvoEF ●HPSF ●THE-DB ●ADDRESS ●Alpaca-Antibody ●CASP7 ●CASP8 ●CASP9 ●CASP10 ●CASP11 ●CASP12 ●CASP13 ●CASP14

GLASS

You can:

Check the ligand table for details.
Go to the GPCR list to see GPCRs with which this ligand interacts.
Go to the individual GPCR page for PubMed ID information by text mining.
Download a TSV version of all interaction data.
Go back to previous page.

Ligand

Name	150-83-4
Molecular formula	C4H7NaO3
IUPAC name	sodium;3-hydroxybutanoate
Molecular weight	126.087
Hydrogen bond acceptor	3
Hydrogen bond donor	1
XlogP	None
Synonyms	Sodium 3-hydroxybutyrate UNII-19AN4ZH292 (??)-Sodium 3-hydroxybutyrate A805718 AKOS015915737 Butanoic acid,3-hydroxy-,sodium salt(1:1) D-(-)-beta-HYDROXYBUTYRIC ACID FT-0650657 MCULE-5681138302 sodium beta-Hydroxybutyrate [R]-3-Hydroxbutanoic acid 3-HYDROXYBUTYRIC ACID SODIUM SALT AB0035567 beta-Hydroxybutyrate sodium salt CHEBI:113373 DL-3-Hydroxybutyric acid, sodium salt, 99% HMS3369G04 S-2094 Sodium DL-Hydroxybutyrate (+-)-3-Hydroxybutanoic acid monosodium salt 4CH-014214 ACMC-209y4i Butanoic acid, 3-hydroxy-, sodium salt (1:1) CS-W011168 EINECS 205-774-5 KB-70854 SCHEMBL194589 sodium 3-oxidanylbutanoate Z3141 A807034 AN-24864 Butyric acid, 3-hydroxy-, monosodium salt, (+/-) DL-3-Hydroxybutyric Acid Sodium Salt H-4000 MFCD00016716 Sodium DL-3-Hydroxybutyrate 3-hydroxybutyric acid, sodium salt AC1Q1V6U Butanoic acid, 3-hydroxy-, monosodium salt DL-beta-Hydroxybutyric acid sodium salt HMS3373C05 S-2994 sodium 3-hydroxybutanoate sodium;3-hydroxybutanoate (+/-)-Sodium 3-hydroxybutyrate A-8576 AK148519 Butanoic acid,3-hydroxy-, sodium salt (1:1) CTK4C6783 FT-0615838 KS-00000ZD8 sodium beta-hydroxybutanoate ZX-AT028296 19AN4ZH292 A809079 bet.-Hydroxybutyrate sodium salt C4H7NaO3 DL-3-Hydroxybutyric acid, sodium salt H-4001 MolPort-001-766-719 Sodium DL-beta-hydroxybutyrate 306-31-0 ACM306310 Butanoic acid, 3-hydroxy-, monosodium salt, (+-)- CHEMBL3973787 EBD2198059 I14-53952 SC-85388 [ Show all ]
Inchi Key	NBPUSGBJDWCHKC-UHFFFAOYSA-M
Inchi ID	InChI=1S/C4H8O3.Na/c1-3(5)2-4(6)7;/h3,5H,2H2,1H3,(H,6,7);/q;+1/p-1
PubChem CID	23676771
ChEMBL	CHEMBL3973787
IUPHAR	N/A
BindingDB	N/A
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	Partition coefficient log P of this ligand is not available.

Known GPCRs

You can:

Click GLASS IDs to check the association information.
Click protein names to check details of the GPCRs.
Download a TSV version of all interaction information.

GLASS ID	Name	UniProt	Gene	Species	Length
541760	Free fatty acid receptor 3	B2GV46	Ffar3	Rattus norvegicus (Rat)	319

zhanglabzhanggroup.org | +65-6601-1241 | Computing 1, 13 Computing Drive, Singapore 117417